SCHEMBL5602181

SCHEMBL5602181

CCCc1cccc2c1[N]c1ccccc1-2

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.33
ADRA2B P18089 3/20 0.32
ADRA2C P18825 3/20 0.32
ADRA2A P08913 2/20 0.32
ELANE P08246 2/20 0.32
GRM5 P41594 1/20 0.32
CTSG P08311 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
HTR1A P08908 1/20 0.31
NISCH Q9Y2I1 1/20 0.31
DAO P14920 1/20 0.30
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 1/20 0.30
PDCD1 Q15116 1/20 0.30
CD274 Q9NZQ7 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5603131 0.90 NR1H2 (0.38) PPARAELANECTSGKDM4EALDH1A1
SCHEMBL5602844 0.88 LIPG (0.44) PPARAELANECTSGNR1H2NR1H3
SCHEMBL5602722 0.87 LIPG (0.46) PPARAELANECTSGNR1H2NR1H3
SCHEMBL5604095 0.87 LIPG (0.46) PPARAELANECTSGNR1H2NR1H3
SCHEMBL5603003 0.87 LIPG (0.46) PPARAELANECTSGNR1H2NR1H3
SCHEMBL5601044 0.87 LIPG (0.46) PPARAELANECTSGNR1H2NR1H3
SCHEMBL5601371 0.87 LIPG (0.46) PPARAELANECTSGNR1H2NR1H3
SCHEMBL5603414 0.87 LIPG (0.46) PPARAELANECTSGNR1H2NR1H3
SCHEMBL5602383 0.87 LIPG (0.46) PPARAELANECTSGNR1H2NR1H3
SCHEMBL5600247 0.85 GABRA1 (0.39) ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed